methyl 2-amino-2-(hydroxymethyl)pent-4-enoate

methyl 2-amino-2-(hydroxymethyl)pent-4-enoate

CAS: 1391022-27-7

Formula: C7H13NO3

SMILES: COC(=O)C(N)(CO)CC=C

IUPAC: methyl 2-amino-2-(hydroxymethyl)pent-4-enoate

InChI: InChI=1/C7H13NO3/c1-3-4-7(8,5-9)6(10)11-2/h3,9H,1,4-5,8H2,2H3

Composition: C (52.82%), H (8.23%), N (8.80%), O (30.15%)

Molar Mass: 159.185

Atom Count: 24

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	159.089543283
Formal Charge	0
FSP3	0.57
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	JJZWCIAFEWQDBH-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	40.69
Topological Polar Surface Area	72.55
Polarizability	16.32
Ring Count	0
Rotatable Bond Count	5

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	1391022-27-7		$207.00-$5,612.00$207.00$299.00$483.00$851.00$1,587.00$5,612.00